methyl 3-nitro-1H-pyrazole-5-carboxylate

Systemtic Name: methyl 3-nitro-1H-pyrazole-5-carboxylate Openeye Name: methyl 3-nitro-1H-pyrazole-5-carboxylate CAS Name: 3-nitro-1H-pyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-nitro-1H-pyrazole-5-carboxylate Traditional Name: 3-nitro-1H-pyrazole-5-carboxylic acid methyl ester Formula: C5H5N3O4 MolecularWeight: 171.1109

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NN1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=NN1)[N+](=O)[O-]

InChI

InChI=1S/C5H5N3O4/c1-12-5(9)3-2-4(7-6-3)8(10)11/h2H,1H3,(H,6,7)